methyl (6S)-3,4-dimethyl-1-methylsulfonyl-6-(trifluoromethyl)-2,5-dihydropyridine-6-carboxylate

Systemtic Name: methyl (6S)-3,4-dimethyl-1-methylsulfonyl-6-(trifluoromethyl)-2,5-dihydropyridine-6-carboxylate Openeye Name: methyl (6S)-3,4-dimethyl-1-methylsulfonyl-6-(trifluoromethyl)-2,5-dihydropyridine-6-carboxylate CAS Name: (6S)-3,4-dimethyl-1-methylsulfonyl-6-(trifluoromethyl)-2,5-dihydropyridine-6-carboxylic acid methyl ester IUPAC Name: methyl (6S)-3,4-dimethyl-1-methylsulfonyl-6-(trifluoromethyl)-2,5-dihydropyridine-6-carboxylate Traditional Name: (6S)-1-mesyl-3,4-dimethyl-6-(trifluoromethyl)-2,5-dihydropyridine-6-carboxylic acid methyl ester Formula: C11H16F3NO4S MolecularWeight: 315.30925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CN(C(C1)(C(=O)OC)C(F)(F)F)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(CN([C@@](C1)(C(=O)OC)C(F)(F)F)S(=O)(=O)C)C

InChI

InChI=1S/C11H16F3NO4S/c1-7-5-10(9(16)19-3,11(12,13)14)15(6-8(7)2)20(4,17)18/h5-6H2,1-4H3/t10-/m0/s1